(phenylmethyl) N-[(2R,3R)-3-oxidanyl-6-oxidanylidene-octadecan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2R,3R)-3-oxidanyl-6-oxidanylidene-octadecan-2-yl]carbamate Openeye Name: benzyl N-[(1R,2R)-2-hydroxy-1-methyl-5-oxo-heptadecyl]carbamate CAS Name: N-[(2R,3R)-3-hydroxy-6-oxooctadecan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2R,3R)-3-hydroxy-6-oxooctadecan-2-yl]carbamate Traditional Name: N-[(1R,2R)-2-hydroxy-5-keto-1-methyl-heptadecyl]carbamic acid benzyl ester Formula: C26H43NO4 MolecularWeight: 433.62392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)CCC(C(C)NC(=O)OCC1=CC=CC=C1)O

Isomeric SMILES

CCCCCCCCCCCCC(=O)CC[C@H]([C@@H](C)NC(=O)OCC1=CC=CC=C1)O

InChI

InChI=1S/C26H43NO4/c1-3-4-5-6-7-8-9-10-11-15-18-24(28)19-20-25(29)22(2)27-26(30)31-21-23-16-13-12-14-17-23/h12-14,16-17,22,25,29H,3-11,15,18-21H2,1-2H3,(H,27,30)/t22-,25-/m1/s1